SCHEMBL2809844

SCHEMBL2809844

CCOC(=O)c1c(-c2ccc(C(C)(C)C)cc2)c2ccccc2n1Cc1cc(O)cc(OS(C)(=O)=O)c1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PPARG P37231 6/20 0.43
SERPINE1 P05121 2/20 0.42
TP53 P04637 1/20 0.39
KMT2A Q03164 3/20 0.38
MEN1 O00255 2/20 0.38
FOLH1 Q04609 1/20 0.38
GAA P10253 3/20 0.38
KDM4E B2RXH2 3/20 0.38
MAPT P10636 2/20 0.38
LMNA P02545 1/20 0.38
PKM P14618 1/20 0.38
MDM2 Q00987 2/20 0.38
MDM4 O15151 1/20 0.38
ALDH1A1 P00352 2/20 0.37
POLB P06746 1/20 0.37
PTGER4 P35408 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
NOD2 Q9HC29 1/20 0.36
NOD1 Q9Y239 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL2809106 0.96 PPARG (0.45) PPARGSERPINE1TP53KMT2AMEN1
SCHEMBL2811167 0.86 PTGER4 (0.42) PPARGSERPINE1TP53KMT2AFOLH1
SCHEMBL2806043 0.85 SERPINE1 (0.41) PPARGSERPINE1TP53KMT2AFOLH1
SCHEMBL2806746 0.83 SERPINE1 (0.46) PPARGSERPINE1TP53ALDH1A1PTGER4
SCHEMBL2807096 0.82 SERPINE1 (0.49) PPARGSERPINE1TP53KMT2AMEN1
SCHEMBL2814267 0.82 SERPINE1 (0.47) PPARGSERPINE1TP53KMT2AMEN1
SCHEMBL2807458 0.81 PPARG (0.45) PPARGSERPINE1KMT2AMEN1FOLH1
SCHEMBL2807202 0.81 PTGER4 (0.44) PPARGSERPINE1TP53KMT2AFOLH1
SCHEMBL2810329 0.79 SERPINE1 (0.42) PPARGSERPINE1KMT2AGAAKDM4E
SCHEMBL13168304 0.79 PPARG (0.41) PPARGSERPINE1KMT2AFOLH1PTGER4

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100240642-A1 1H-Indole-2-Carboxylic Acid Derivatives Useful As PPAR Modulators SMITHKLINE BEECHAM CORPORATION (US) 2010-09-23 US disclosed
EP-2081894-A1 1H-INDOLE-2-CARBOXYLIC ACID DERIVATIVES USEFUL AS PPAR MODULATORS SmithKline Beecham Corporation (US) 2009-07-29 EP disclosed
WO-2008028118-A1 1H-INDOLE-2-CARBOXYLIC ACID DERIVATIVES USEFUL AS PPAR MODULATORS SMITHKLINE BEECHAM CORPORAITON (US) 2008-03-06 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100240642-A1 1H-Indole-2-Carboxylic Acid Derivatives Useful As PPAR Modulators PPARD, PPARA, PPARG PPARG 3/4885SERPINE1 4215/4885TP53 1320/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.